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2-[2-(azocan-1-ium-1-ylmethyl)-6-chloranyl-benzimidazol-1-yl]ethanol

2-[2-(azocan-1-ium-1-ylmethyl)-6-chloranyl-benzimidazol-1-yl]ethanol

Systemtic Name:2-[2-(azocan-1-ium-1-ylmethyl)-6-chloranyl-benzimidazol-1-yl]ethanol
Openeye Name:2-[2-(azocan-1-ium-1-ylmethyl)-6-chloro-benzimidazol-1-yl]ethanol
CAS Name:2-[2-(1-azocan-1-iumylmethyl)-6-chloro-1-benzimidazolyl]ethanol
IUPAC Name:2-[2-(azocan-1-ium-1-ylmethyl)-6-chlorobenzimidazol-1-yl]ethanol
Traditional Name:2-[2-(azocan-1-ium-1-ylmethyl)-6-chloro-benzimidazol-1-yl]ethanol
Formula: C17H25ClN3O+
MolecularWeight: 322.8529
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CCC1)CC2=NC3=C(N2CCO)C=C(C=C3)Cl


Isomeric SMILES

C1CCC[NH+](CCC1)CC2=NC3=C(N2CCO)C=C(C=C3)Cl


InChI

InChI=1S/C17H24ClN3O/c18-14-6-7-15-16(12-14)21(10-11-22)17(19-15)13-20-8-4-2-1-3-5-9-20/h6-7,12,22H,1-5,8-11,13H2/p+1


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